ChemSpider 2D Image | N-[(1,3-Dimethyl-1H-pyrazol-4-yl)methyl]-2-(4-fluorophenyl)-1-[1-(3-furylmethyl)-4-piperidinyl]-N-methylethanamine | C25H33FN4O

N-[(1,3-Dimethyl-1H-pyrazol-4-yl)methyl]-2-(4-fluorophenyl)-1-[1-(3-furylmethyl)-4-piperidinyl]-N-methylethanamine

  • Molecular FormulaC25H33FN4O
  • Average mass424.554 Da
  • Monoisotopic mass424.263855 Da
  • ChemSpider ID23069261

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4-Piperidinemethanamine, N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-α-[(4-fluorophenyl)methyl]-1-(3-furanylmethyl)-N-methyl- [ACD/Index Name]
N-[(1,3-Dimethyl-1H-pyrazol-4-yl)methyl]-2-(4-fluorophenyl)-1-[1-(3-furylmethyl)-4-piperidinyl]-N-methylethanamine [ACD/IUPAC Name]
N-[(1,3-Diméthyl-1H-pyrazol-4-yl)méthyl]-2-(4-fluorophényl)-1-[1-(3-furylméthyl)-4-pipéridinyl]-N-méthyléthanamine [French] [ACD/IUPAC Name]
N-[(1,3-Dimethyl-1H-pyrazol-4-yl)methyl]-2-(4-fluorphenyl)-1-[1-(3-furylmethyl)-4-piperidinyl]-N-methylethanamin [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 522.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.6±3.0 kJ/mol
Flash Point: 269.8±30.1 °C
Index of Refraction: 1.591
Molar Refractivity: 123.2±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.82
ACD/LogD (pH 5.5): 0.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 2.55
ACD/BCF (pH 7.4): 22.09
ACD/KOC (pH 7.4): 118.93
Polar Surface Area: 37 Å2
Polarizability: 48.8±0.5 10-24cm3
Surface Tension: 40.4±7.0 dyne/cm
Molar Volume: 364.6±7.0 cm3

Click to predict properties on the Chemicalize site


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